2-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonylamino)ethanoic acid

Systemtic Name: 2-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonylamino)ethanoic acid Openeye Name: 2-(4,5-dihydrobenzo[g]benzothiophene-2-carbonylamino)acetic acid CAS Name: 2-[[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methyl]amino]acetic acid IUPAC Name: 2-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonylamino)acetic acid Traditional Name: 2-(4,5-dihydrobenzo[g]benzothiophene-2-carbonylamino)acetic acid Formula: C15H13NO3S MolecularWeight: 287.33362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)NCC(=O)O

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)NCC(=O)O

InChI

InChI=1S/C15H13NO3S/c17-13(18)8-16-15(19)12-7-10-6-5-9-3-1-2-4-11(9)14(10)20-12/h1-4,7H,5-6,8H2,(H,16,19)(H,17,18)